rel-(3R,4S)-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-[(propan-2-yl)amino]-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-[(propan-2-yl)amino]-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-[(propan-2-yl)amino]-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-2077 |
| Compound Name: | rel-(3R,4S)-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-[(propan-2-yl)amino]-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 349.44 |
| Molecular Formula: | C14 H20 F N O4 S2 |
| Smiles: | CC(C)N[C@H]1CS(C[C@@H]1S(c1ccc(c(C)c1)F)(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.1728 |
| logD: | 1.1712 |
| logSw: | -2.2455 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.094 |
| InChI Key: | JLVZQODTOTUAEE-ZIAGYGMSSA-N |